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Details

Stereochemistry RACEMIC
Molecular Formula C16H11N3O2
Molecular Weight 277.278
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of INDIRUBIN-3'-MONOXIME

SMILES

c1ccc2=NC(=O)C(=c2c1)C3/C(=N/O)/c4ccccc4N3

InChI

InChIKey=BEWDUFPLKKFTGI-XMHGGMMESA-N
InChI=1S/C16H11N3O2/c20-16-13(9-5-1-3-7-11(9)18-16)15-14(19-21)10-6-2-4-8-12(10)17-15/h1-8,15,17,21H/b19-14+

HIDE SMILES / InChI

Molecular Formula C16H11N3O2
Molecular Weight 277.278
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 15:49:12 UTC 2021
Edited
by admin
on Sat Jun 26 15:49:12 UTC 2021
Record UNII
X6CSG51MBQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
INDIRUBIN-3'-MONOXIME
Common Name English
2H-INDOL-2-ONE, 3-(1,3-DIHYDRO-3-(HYDROXYIMINO)-2H-INDOL-2-YLIDENE)-1,3-DIHYDRO-
Systematic Name English
INDIRUBIN 3'-MONOXIME
Common Name English
INDIRUBIN 3-OXIME
Common Name English
3-(HYDROXYIMINO)-(2,3'-BIINDOLINYLIDENE)-2'-ONE
Systematic Name English
3-(1,3-DIHYDRO-3-(HYDROXYIMINO)-2H-INDOL-2-YLIDENE)-1,3-DIHYDRO-2H-INDOL-2-ONE
Systematic Name English
Code System Code Type Description
DRUG BANK
DB02052
Created by admin on Sat Jun 26 15:49:12 UTC 2021 , Edited by admin on Sat Jun 26 15:49:12 UTC 2021
PRIMARY
CAS
1110670-53-5
Created by admin on Sat Jun 26 15:49:12 UTC 2021 , Edited by admin on Sat Jun 26 15:49:12 UTC 2021
ALTERNATIVE
EPA CompTox
160807-49-8
Created by admin on Sat Jun 26 15:49:12 UTC 2021 , Edited by admin on Sat Jun 26 15:49:12 UTC 2021
PRIMARY
PUBCHEM
5326739
Created by admin on Sat Jun 26 15:49:12 UTC 2021 , Edited by admin on Sat Jun 26 15:49:12 UTC 2021
PRIMARY
CAS
160807-49-8
Created by admin on Sat Jun 26 15:49:12 UTC 2021 , Edited by admin on Sat Jun 26 15:49:12 UTC 2021
PRIMARY
FDA UNII
X6CSG51MBQ
Created by admin on Sat Jun 26 15:49:12 UTC 2021 , Edited by admin on Sat Jun 26 15:49:12 UTC 2021
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
TARGET -> INHIBITOR